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SMILES: COC(=O)c1nn2c(cc(nc2c1Br)-c1ccc(Br)o1)C(F)(F)F

InChI Key: InChIKey=ITWNUCXLIIBMTG-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 83472   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83472
PNG
(3-bromo-5-(5-bromo-2-furanyl)-7-(trifluoromethyl)-...)
Show SMILES COC(=O)c1nn2c(cc(nc2c1Br)-c1ccc(Br)o1)C(F)(F)F
Show InChI InChI=1S/C13H6Br2F3N3O3/c1-23-12(22)10-9(15)11-19-5(6-2-3-8(14)24-6)4-7(13(16,17)18)21(11)20-10/h2-4H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.05E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2TB15DB
More data for this
Ligand-Target Pair
Endoribonuclease toxin MazF


(Escherichia coli str. K-12 substr. MG1655)
BDBM83472
PNG
(3-bromo-5-(5-bromo-2-furanyl)-7-(trifluoromethyl)-...)
Show SMILES COC(=O)c1nn2c(cc(nc2c1Br)-c1ccc(Br)o1)C(F)(F)F
Show InChI InChI=1S/C13H6Br2F3N3O3/c1-23-12(22)10-9(15)11-19-5(6-2-3-8(14)24-6)4-7(13(16,17)18)21(11)20-10/h2-4H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>9.90E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2Z31X54
More data for this
Ligand-Target Pair